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Samarium,4,4-trifluoro-1-(2-thienyl)-1,3-butanedionato]-

HCID 425455
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Basic information

CAS
14054-92-3
Standard SMILES
O=C(CC(=O)C(F)(F)F)c1cccs1.O=C(CC(=O)C(F)(F)F)c1cccs1.O=C(CC(=O)C(F)(F)F)c1cccs1.[Sm]
InChIKey
UJOZDQULAPEUIV-UHFFFAOYSA-N
Molecular formula
C24H15F9O6S3Sm
Average molar mass
816.9 g/mol
Monoisotopic mass
817.90844

Names & identifiers

Preferred name
Samarium,4,4-trifluoro-1-(2-thienyl)-1,3-butanedionato]-
IUPAC
samarium;tris(4,4,4-trifluoro-1-thiophen-2-ylbutane-1,3-dione)

Names & synonyms

NSC174290NSC-174290Samarium,4,4-trifluoro-1-(2-thienyl)-1,3-butanedionato]-Samarium,4,4-trifluoro-1-(2-thienyl)-1,3-butanedionato-O,O']-

Database identifiers

CAS
14054-92-3
PubChem CID
425455

Properties

Computed structural properties

Topological polar surface area
187 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
18
Rotatable bonds
3
Heavy atoms
43
Formal charge
0
Complexity
879

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